337803 <common-name>2-[4-[(e)-2-(4-chloro-2-sulfophenyl)ethenyl]-3-sulfophenyl]benzo[e]benzotriazole-6-sulfonic acid</common-name> <description>2-[4-[(e)-2-(4-chloro-2-sulfophenyl)ethenyl]-3-sulfophenyl]benzo[e]benzotriazole-6-sulfonic acid has the chemical formula C24H16ClN3O9S3. With an average molecular weight of 622.10 g/mol, 2-[4-[(e)-2-(4-chloro-2-sulfophenyl)ethenyl]-3-sulfophenyl]benzo[e]benzotriazole-6-sulfonic acid is a heavy molecule.</description> <cas nil="true"/> <pubchem-id>6447351</pubchem-id> <chemical-formula>C24H16ClN3O9S3</chemical-formula> <weight>622.1</weight> <appearance nil="true"/> <melting-point nil="true"/> <boiling-point nil="true"/> <density nil="true"/> <solubility nil="true"/> <specific-gravity nil="true"/> <flash-point nil="true"/> <vapour-pressure nil="true"/> <route-of-exposure nil="true"/> <target nil="true"/> <mechanism-of-toxicity nil="true"/> <metabolism nil="true"/> <toxicity nil="true"/> <lethaldose nil="true"/> <carcinogenicity nil="true"/> <use-source nil="true"/> <min-risk-level nil="true"/> <health-effects nil="true"/> <symptoms nil="true"/> <treatment nil="true"/> <created-at type="dateTime">2026-08-30T20:46:07Z</created-at> <updated-at type="dateTime">2026-08-30T20:46:07Z</updated-at> <interacting-proteins nil="true"/> <wikipedia nil="true"/> <uniprot-id nil="true"/> <kegg-compound-id nil="true"/> <omim-id nil="true"/> <chebi-id nil="true"/> <biocyc-id nil="true"/> <ctd-id nil="true"/> <stitch-id nil="true"/> <drugbank-id nil="true"/> <pdb-id nil="true"/> <actor-id nil="true"/> <organism nil="true"/> <export type="boolean">true</export> <metabolizing-proteins nil="true"/> <transporting-proteins nil="true"/> <moldb-smiles>C1=CC2=C(C=CC3=NN(N=C23)C4=CC(=C(C=C4)C=CC5=C(C=C(C=C5)Cl)S(=O)(=O)O)S(=O)(=O)O)C(=C1)S(=O)(=O)O</moldb-smiles> <moldb-formula>C24H16ClN3O9S3</moldb-formula> <moldb-inchi>InChI=1S/C24H16ClN3O9S3/c25-16-8-6-14(22(12-16)39(32,33)34)4-5-15-7-9-17(13-23(15)40(35,36)37)28-26-20-11-10-18-19(24(20)27-28)2-1-3-21(18)38(29,30)31/h1-13H,(H,29,30,31)(H,32,33,34)(H,35,36,37)/b5-4+</moldb-inchi> <moldb-inchikey>AMMVQETUPXPHPE-SNAWJCMRSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">620.9737203</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3.7</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id nil="true"/> <structure-image-file-name nil="true"/> <structure-image-content-type nil="true"/> <structure-image-file-size type="integer" nil="true"/> <structure-image-updated-at type="dateTime" nil="true"/> <biodb-id nil="true"/> <synthesis-reference nil="true"/> <structure-image-caption nil="true"/> <chemdb-id>CHEM333696</chemdb-id> <dsstox-id nil="true"/> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id nil="true"/> <iupac>2-[4-[(e)-2-(4-chloro-2-sulfophenyl)ethenyl]-3-sulfophenyl]benzo[e]benzotriazole-6-sulfonic acid</iupac> <moldb-polar-surface-area nil="true"/> <moldb-refractivity nil="true"/> <moldb-polarizability nil="true"/> <moldb-rotatable-bond-count nil="true"/> <moldb-acceptor-count nil="true"/> <moldb-donor-count nil="true"/> <moldb-pka-strongest-acidic nil="true"/> <moldb-pka-strongest-basic nil="true"/> <moldb-physiological-charge nil="true"/> <moldb-number-of-rings nil="true"/> <moldb-alogps-logp nil="true"/> <moldb-alogps-logs nil="true"/> <moldb-alogps-solubility nil="true"/> <kingdom>Organic compounds</kingdom> <superklass>Phenylpropanoids and polyketides</superklass> <klass>Stilbenes</klass> <subklass>Sulfonated stilbenes</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0288232</sync-id> <structure-inchikey>AMMVQETUPXPHPE-UHFFFAOYSA-N</structure-inchikey> 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